{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9561271 0.2009027 2.827783 ] [ 0.6408175 2.004915 2.928704 ] [ 2.494403 2.793601 0.1007886 ] [ 2.213716 1.735143 2.110523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.561271000000001e-11 2.009027e-11 2.827783e-10 ] [ 6.408175e-11 2.004915e-10 2.928704e-10 ] [ 2.494403e-10 2.793601e-10 1.007886e-11 ] [ 2.213716e-10 1.735143e-10 2.110523e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9041713 -23.4454187 1.7365243 ] [ -20.8426254 20.3403501 10.4966815 ] [ 0.1530122 -0.1095012 -0.1150446 ] [ 22.5937845 3.2145698 -12.1181612 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.050818738858343e-09 -3.756370170600714e-08 2.782218634911085e-09 ] [ -3.339356713197225e-08 3.258883338910694e-08 1.681753769528387e-08 ] [ 2.451525695371737e-10 -1.75440262589545e-10 -1.843217684692877e-10 ] [ 3.619923330129342e-08 5.150308579489731e-09 -1.941543456172567e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.3523878 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.768940736215146e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.001462 -0.0746747 2.6993645 ] [ 0.2623101 2.2163569 3.3747843 ] [ 2.7000765 2.6698387 -0.1233765 ] [ 2.3412149 1.9230408 2.0170263 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.001462e-10 -7.46747e-12 2.6993645e-10 ] [ 2.623101e-11 2.2163569e-10 3.3747843e-10 ] [ 2.7000765e-10 2.6698387e-10 -1.233765e-11 ] [ 2.3412149e-10 1.9230408e-10 2.0170263e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.9e-06 6.1e-06 0.0 ] [ 4.6e-06 -6.6e-06 6e-06 ] [ 1.4e-05 6.5e-06 -2.73e-05 ] [ -2.05e-05 -6e-06 2.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.04413557952e-15 9.77327738688e-15 0.0 ] [ 7.370012455680001e-15 -1.057436569728e-14 9.6130597248e-15 ] [ 2.24304726912e-14 1.04141480352e-14 -4.373942174784e-14 ] [ -3.28446207264e-14 -9.6130597248e-15 3.396614436096001e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.4752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.197659067580416e-18 } }